#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1aou n ILE 2 N 0.00 0.00 0.00 0.44 -5.35 -1.26 -4.70 119.36 108.49 1aou n ILE 2 Ca 0.00 0.35 0.00 0.00 -0.27 0.00 0.00 62.75 62.83 1aou n ILE 2 Cb 0.00 -0.96 0.00 0.00 -1.74 0.00 0.00 39.64 36.94 1aou n ILE 2 CO 0.00 0.00 0.00 1.67 -1.76 0.00 0.00 176.55 176.46 1aou n GLN 3 N 0.00 0.00 0.00 6.28 -0.06 -1.26 -5.06 117.38 117.28 1aou n GLN 3 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 55.00 1aou n GLN 3 Cb 0.00 0.00 0.00 0.00 -4.06 0.00 0.00 30.24 26.18 1aou n GLN 3 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 1aou n ALA 4 N -3.00 0.00 0.00 1.69 0.00 -1.26 -5.01 120.51 112.93 1aou n ALA 4 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1aou n ALA 4 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1aou n ALA 4 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 1aou n GLU 5 N -0.19 0.00 -0.08 0.00 0.28 -0.84 -4.77 120.64 115.03 1aou n GLU 5 Ca 0.00 0.00 -0.10 0.00 -0.16 0.00 0.00 57.16 56.90 1aou n GLU 5 Cb 0.00 0.00 -0.07 0.00 1.43 0.00 0.00 31.44 32.80 1aou n GLU 5 CO 0.00 0.00 0.00 0.93 -0.16 0.00 0.00 177.13 177.90 1aou h GLU 6 N 0.00 -0.29 -0.09 3.44 5.08 -1.97 -3.12 114.58 117.63 1aou h GLU 6 Ca 0.00 0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 1aou h GLU 6 Cb 0.00 0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.32 1aou h GLU 6 CO 0.00 -0.20 0.00 -2.67 -1.00 0.00 0.00 179.01 175.14 1aou n TRP 7 N -4.59 0.15 -3.26 4.33 4.27 -1.26 -4.43 117.44 112.65 1aou n TRP 7 Ca -0.03 -0.60 -0.05 0.00 -3.89 0.00 0.00 57.50 52.93 1aou n TRP 7 Cb 0.25 -0.07 -0.04 0.00 -1.36 0.00 0.00 31.31 30.08 1aou n TRP 7 CO 0.00 0.00 0.00 -0.47 -2.29 0.00 0.00 177.69 174.93 1aou s TYR 8 N -1.38 -1.24 0.21 -2.67 6.14 -1.18 0.26 117.35 117.50 1aou s TYR 8 Ca 0.12 0.40 -0.05 0.00 0.64 0.00 0.00 57.07 58.17 1aou s TYR 8 Cb 0.09 -0.01 0.18 0.00 0.42 0.00 0.00 41.96 42.63 1aou s TYR 8 CO 0.04 -1.03 1.65 0.74 0.64 0.00 0.00 175.55 177.59 1aou h PHE 9 N 7.90 0.95 0.00 4.97 -1.00 -1.28 -2.22 116.94 126.25 1aou h PHE 9 Ca -0.04 -0.19 0.00 0.00 2.81 0.00 0.00 57.97 60.55 1aou h PHE 9 Cb 1.14 -0.24 0.00 0.00 3.61 0.00 0.00 35.95 40.46 1aou h PHE 9 CO 0.26 0.93 0.00 0.41 -1.61 0.00 0.00 178.31 178.30 1aou n GLY 10 N -0.32 0.41 2.75 -1.45 0.00 -1.25 -4.73 105.19 100.59 1aou n GLY 10 Ca 0.01 -0.90 -0.34 0.00 0.00 0.00 0.00 46.02 44.79 1aou n GLY 10 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1aou n LYS 11 N 0.00 3.14 -3.30 1.61 5.02 -1.26 -1.62 118.16 121.76 1aou n LYS 11 Ca 0.00 -4.60 -0.17 0.00 -2.02 0.00 0.00 58.31 51.52 1aou n LYS 11 Cb 0.00 -2.37 -0.03 0.00 -0.02 0.00 0.00 35.03 32.61 1aou n LYS 11 CO 0.00 0.00 0.00 1.47 -0.52 0.00 0.00 177.40 178.35 1aou n LEU 12 N 1.29 0.00 -4.91 -0.35 -0.00 -1.26 -4.79 117.00 106.98 1aou n LEU 12 Ca 0.27 -1.64 -0.30 0.00 -0.00 0.00 0.00 56.01 54.34 1aou n LEU 12 Cb 0.38 0.15 -0.04 0.00 -0.00 0.00 0.00 43.42 43.91 1aou n LEU 12 CO 0.50 -0.27 0.01 -0.83 -0.00 0.00 0.00 177.39 176.80 1aou s GLY 13 N -2.54 2.04 0.61 1.47 0.00 -1.26 -4.05 107.32 103.60 1aou s GLY 13 Ca 0.02 -0.70 0.35 0.00 0.00 0.00 0.00 44.72 44.39 1aou s GLY 13 CO 0.02 -0.64 2.27 0.07 0.00 0.00 0.00 173.10 174.82 1aou h ARG 14 N 2.49 0.00 0.00 2.90 -0.00 -1.96 0.17 114.38 117.97 1aou h ARG 14 Ca -0.47 0.00 -0.14 0.00 -0.00 0.00 0.00 59.98 59.37 1aou h ARG 14 Cb 1.18 0.00 -0.02 0.00 -0.00 0.00 0.00 29.97 31.13 1aou h ARG 14 CO 0.71 0.01 -0.67 -0.22 -0.00 0.00 0.00 179.97 179.81 1aou h LYS 15 N 0.00 0.00 -0.10 0.08 3.64 -2.00 -2.61 116.57 115.58 1aou h LYS 15 Ca -0.00 0.00 -0.18 0.00 -1.27 0.00 0.00 60.65 59.20 1aou h LYS 15 Cb 0.06 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 31.87 1aou h LYS 15 CO 0.00 0.67 -0.70 0.22 -2.27 0.00 0.00 179.45 177.37 1aou h ASP 16 N 0.00 0.53 -0.49 4.20 3.58 -1.07 -2.76 116.42 120.41 1aou h ASP 16 Ca -0.01 -0.34 -0.06 0.00 0.42 0.00 0.00 57.03 57.04 1aou h ASP 16 Cb 1.20 -0.16 -0.02 0.00 1.72 0.00 0.00 39.33 42.07 1aou h ASP 16 CO 0.09 1.07 0.08 0.00 -2.88 0.00 0.00 179.24 177.60 1aou h ALA 17 N 0.92 1.11 -0.22 -0.78 0.00 -1.19 0.56 119.26 119.66 1aou h ALA 17 Ca -0.02 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.63 1aou h ALA 17 Cb 1.27 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.83 1aou h ALA 17 CO 0.12 0.58 0.08 0.93 0.00 0.00 0.00 179.25 180.96 1aou h GLU 18 N 0.83 0.33 0.00 0.00 5.08 -1.33 -0.67 114.58 118.83 1aou h GLU 18 Ca 0.17 -0.07 -0.02 0.00 -1.00 0.00 0.00 59.36 58.44 1aou h GLU 18 Cb 0.38 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.58 1aou h GLU 18 CO 0.01 0.41 -0.11 -0.09 -1.00 0.00 0.00 179.01 178.23 1aou h ARG 19 N 0.19 0.00 0.00 2.33 1.12 -1.19 -2.47 114.38 114.36 1aou h ARG 19 Ca 0.07 0.00 0.00 0.00 -1.11 0.00 0.00 59.98 58.94 1aou h ARG 19 Cb 0.21 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 30.17 1aou h ARG 19 CO -0.00 0.11 0.00 0.94 -3.11 0.00 0.00 179.97 177.91 1aou n GLN 20 N -3.38 0.00 -0.28 0.20 -0.06 0.16 -1.76 117.38 112.26 1aou n GLN 20 Ca -0.01 0.45 -0.09 0.00 -2.00 0.00 0.00 57.00 55.35 1aou n GLN 20 Cb 0.30 -0.96 -0.06 0.00 -4.06 0.00 0.00 30.24 25.46 1aou n GLN 20 CO 0.00 0.00 0.00 -0.07 -0.20 0.00 0.00 177.06 176.79 1aou h LEU 21 N 0.00 -1.75 -0.72 1.69 3.38 -1.24 0.53 115.31 117.20 1aou h LEU 21 Ca 0.00 0.28 0.09 0.00 0.09 0.00 0.00 57.88 58.34 1aou h LEU 21 Cb 0.00 0.79 -0.07 0.00 0.09 0.00 0.00 40.66 41.47 1aou h LEU 21 CO 0.00 -0.31 0.37 -0.07 0.09 0.00 0.00 178.44 178.52 1aou h LEU 22 N -0.17 0.50 -3.30 1.67 3.38 -1.62 0.49 115.31 116.27 1aou h LEU 22 Ca 0.18 0.06 -0.30 0.00 0.09 0.00 0.00 57.88 57.90 1aou h LEU 22 Cb 0.53 -0.03 -0.14 0.00 0.09 0.00 0.00 40.66 41.10 1aou h LEU 22 CO -0.78 0.29 0.39 -1.20 0.09 0.00 0.00 178.44 177.23 1aou n SER 23 N -4.84 5.39 0.00 -0.43 7.64 0.16 -4.85 113.62 116.69 1aou n SER 23 Ca 0.11 -2.97 0.00 0.00 1.01 0.00 0.00 58.87 57.02 1aou n SER 23 Cb 0.26 -0.92 0.00 0.00 -1.01 0.00 0.00 64.21 62.54 1aou n SER 23 CO 0.00 0.00 0.00 0.33 -3.01 0.00 0.00 175.04 172.36 1aou n PHE 24 N 0.11 0.00 -0.87 1.43 7.35 0.30 -4.87 117.46 120.91 1aou n PHE 24 Ca 0.30 0.00 0.03 0.00 -0.76 0.00 0.00 57.45 57.02 1aou n PHE 24 Cb 0.75 0.00 0.04 0.00 0.35 0.00 0.00 39.48 40.62 1aou n PHE 24 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1aou n GLY 25 N 5.00 1.69 3.39 7.13 0.00 -1.26 -5.04 105.19 116.10 1aou n GLY 25 Ca 0.00 -0.30 -0.32 0.00 0.00 0.00 0.00 46.02 45.40 1aou n GLY 25 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1aou s ASN 26 N -1.27 3.55 1.01 1.61 0.02 -1.26 -5.04 114.94 113.55 1aou s ASN 26 Ca 0.08 -0.33 -0.05 0.00 -1.02 0.00 0.00 52.86 51.55 1aou s ASN 26 Cb 0.07 -0.61 0.06 0.00 0.02 0.00 0.00 41.25 40.79 1aou s ASN 26 CO 0.01 0.33 0.35 -0.81 0.02 0.00 0.00 177.10 177.00 1aou n PRO 27 N 2.39 -0.46 -0.81 -0.60 -0.04 -1.26 -4.88 135.00 129.33 1aou n PRO 27 Ca -0.17 -0.54 -0.32 0.00 -0.04 0.00 0.00 63.50 62.43 1aou n PRO 27 Cb 0.52 -0.37 0.09 0.00 -0.04 0.00 0.00 33.50 33.70 1aou n PRO 27 CO 0.00 0.00 0.00 2.89 -0.04 0.00 0.00 175.50 178.35 1aou n ARG 28 N -1.81 -0.84 -0.41 0.54 1.85 -1.26 -3.69 116.66 111.05 1aou n ARG 28 Ca 0.04 -0.24 0.00 0.00 -1.00 0.00 0.00 57.85 56.65 1aou n ARG 28 Cb 0.15 -1.31 0.00 0.00 -1.05 0.00 0.00 32.46 30.26 1aou n ARG 28 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1aou n GLY 29 N 2.82 0.77 3.15 2.89 0.00 -0.15 -4.92 105.19 109.75 1aou n GLY 29 Ca -0.00 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.58 1aou n GLY 29 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1aou n THR 30 N -2.00 4.85 -2.98 2.61 -1.04 -1.24 -2.17 114.28 112.31 1aou n THR 30 Ca 0.00 -5.45 -0.43 0.00 -2.04 0.00 0.00 64.05 56.13 1aou n THR 30 Cb 0.00 -2.33 -0.05 0.00 -1.82 0.00 0.00 70.33 66.13 1aou n THR 30 CO 0.00 0.00 0.00 -0.36 -0.64 0.00 0.00 175.07 174.07 1aou s PHE 31 N -1.47 2.98 0.55 -1.42 0.08 -1.08 -1.97 117.98 115.65 1aou s PHE 31 Ca 0.33 0.06 0.08 0.00 0.12 0.00 0.00 56.93 57.53 1aou s PHE 31 Cb -0.01 -3.68 0.06 0.00 -0.57 0.00 0.00 43.02 38.83 1aou s PHE 31 CO 0.02 -1.03 0.65 -0.48 -0.10 0.00 0.00 175.22 174.28 1aou s LEU 32 N 3.28 3.05 0.41 -0.37 0.05 0.14 0.26 118.68 125.50 1aou s LEU 32 Ca 0.28 -0.92 0.07 0.00 0.05 0.00 0.00 54.13 53.61 1aou s LEU 32 Cb -0.13 -1.61 -0.08 0.00 -2.05 0.00 0.00 46.19 42.33 1aou s LEU 32 CO 0.21 -1.21 0.02 -0.63 -0.55 0.00 0.00 176.35 174.20 1aou s ILE 33 N -2.66 2.04 0.00 1.48 1.01 0.73 0.11 121.20 123.91 1aou s ILE 33 Ca 0.53 -1.98 0.00 0.00 0.00 0.00 0.00 60.65 59.21 1aou s ILE 33 Cb -0.05 -2.99 0.00 0.00 0.01 0.00 0.00 42.46 39.44 1aou s ILE 33 CO 0.33 -0.01 0.00 -2.11 0.00 0.00 0.00 174.94 173.15 1aou n ARG 34 N -0.99 0.00 -2.45 2.79 1.85 -0.84 -1.16 116.66 115.85 1aou n ARG 34 Ca -0.05 0.00 -0.41 0.00 -1.00 0.00 0.00 57.85 56.39 1aou n ARG 34 Cb 0.67 0.00 -0.03 0.00 -1.05 0.00 0.00 32.46 32.04 1aou n ARG 34 CO 0.00 0.00 0.00 -1.21 -0.01 0.00 0.00 177.63 176.41 1aou s GLU 35 N -2.00 4.51 -0.17 2.89 2.02 -0.64 0.13 118.70 125.44 1aou s GLU 35 Ca 0.00 1.76 -0.27 0.00 0.02 0.00 0.00 54.97 56.49 1aou s GLU 35 Cb 0.00 -3.30 -0.01 0.00 0.10 0.00 0.00 34.13 30.92 1aou s GLU 35 CO 0.00 -0.10 0.91 -1.12 0.02 0.00 0.00 175.26 174.97 1aou s SER 36 N 0.44 7.04 -0.02 -0.19 0.01 -0.30 -4.32 113.70 116.37 1aou s SER 36 Ca 0.54 1.29 0.08 0.00 1.31 0.00 0.00 55.95 59.17 1aou s SER 36 Cb -0.30 -2.49 0.27 0.00 0.21 0.00 0.00 66.02 63.71 1aou s SER 36 CO 0.33 -0.46 1.16 -0.62 0.41 0.00 0.00 173.24 174.06 1aou n GLU 37 N 5.38 1.89 0.00 12.44 -0.58 -1.26 -2.83 120.64 135.68 1aou n GLU 37 Ca 0.07 -1.10 -0.18 0.00 -0.42 0.00 0.00 57.16 55.53 1aou n GLU 37 Cb 0.48 -1.37 -0.10 0.00 -0.57 0.00 0.00 31.44 29.88 1aou n GLU 37 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1aou h THR 38 N 1.68 1.39 -4.46 2.62 1.03 -1.96 -3.47 112.91 109.73 1aou h THR 38 Ca 0.00 -2.06 -0.13 0.00 -0.01 0.00 0.00 66.41 64.20 1aou h THR 38 Cb 0.56 2.49 -0.01 0.00 -1.07 0.00 0.00 68.15 70.12 1aou h THR 38 CO 0.05 0.61 -0.06 1.07 -0.01 0.00 0.00 175.52 177.18 1aou n THR 39 N -4.16 0.00 -0.40 0.00 5.66 -1.25 -4.95 114.28 109.18 1aou n THR 39 Ca -0.10 -0.51 0.33 0.00 -3.05 0.00 0.00 64.05 60.72 1aou n THR 39 Cb 0.70 -0.47 0.60 0.00 -1.55 0.00 0.00 70.33 69.61 1aou n THR 39 CO 0.00 0.00 0.00 0.11 -3.05 0.00 0.00 175.07 172.13 1aou h LYS 40 N 0.00 0.14 0.00 1.09 1.57 -1.89 -3.39 116.57 114.08 1aou h LYS 40 Ca -0.08 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.69 1aou h LYS 40 Cb 0.30 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.58 1aou h LYS 40 CO 0.12 0.09 0.00 0.41 -0.57 0.00 0.00 179.45 179.50 1aou n GLY 41 N -1.46 -1.73 0.00 3.86 0.00 -1.26 -5.01 105.19 99.59 1aou n GLY 41 Ca 0.35 0.70 0.00 0.00 0.00 0.00 0.00 46.02 47.07 1aou n GLY 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1aou n ALA 42 N 0.00 0.00 -4.40 4.61 0.00 -1.13 -4.81 120.51 114.79 1aou n ALA 42 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 53.44 53.25 1aou n ALA 42 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.41 1aou n ALA 42 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1aou n TYR 43 N 0.00 0.58 -3.85 0.00 4.01 -0.57 -1.15 117.16 116.18 1aou n TYR 43 Ca 0.00 -1.47 -0.07 0.00 -0.16 0.00 0.00 57.90 56.20 1aou n TYR 43 Cb 0.00 -0.20 -0.02 0.00 -0.31 0.00 0.00 39.34 38.81 1aou n TYR 43 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 1aou s SER 44 N -2.66 -0.23 -0.37 7.72 0.15 0.35 -0.81 113.70 117.86 1aou s SER 44 Ca 0.01 -0.64 0.03 0.00 0.70 0.00 0.00 55.95 56.05 1aou s SER 44 Cb -0.00 0.72 0.16 0.00 -1.71 0.00 0.00 66.02 65.19 1aou s SER 44 CO 0.01 -1.35 0.40 -0.22 1.20 0.00 0.00 173.24 173.27 1aou s LEU 45 N -2.94 -0.23 0.87 3.45 2.96 0.59 -1.99 118.68 121.39 1aou s LEU 45 Ca 0.11 -1.41 -0.12 0.00 -0.22 0.00 0.00 54.13 52.50 1aou s LEU 45 Cb -0.06 0.71 0.11 0.00 0.50 0.00 0.00 46.19 47.45 1aou s LEU 45 CO 0.07 -0.26 1.10 -0.55 -1.32 0.00 0.00 176.35 175.39 1aou s SER 46 N 1.57 3.76 -0.06 3.68 0.15 0.30 -0.62 113.70 122.47 1aou s SER 46 Ca 0.16 1.35 -0.02 0.00 0.70 0.00 0.00 55.95 58.14 1aou s SER 46 Cb -0.14 -2.04 0.04 0.00 -1.71 0.00 0.00 66.02 62.16 1aou s SER 46 CO -0.07 -2.44 0.11 0.27 1.20 0.00 0.00 173.24 172.32 1aou s ILE 47 N -3.04 -0.12 -0.12 6.45 -4.36 -0.50 -0.69 121.20 118.82 1aou s ILE 47 Ca 0.63 0.28 -0.24 0.00 -0.26 0.00 0.00 60.65 61.05 1aou s ILE 47 Cb -0.16 -0.21 -0.03 0.00 1.25 0.00 0.00 42.46 43.31 1aou s ILE 47 CO 0.56 0.11 0.74 -0.60 0.24 0.00 0.00 174.94 175.99 1aou s ARG 48 N 1.63 4.36 -0.36 0.37 6.06 -0.83 -1.00 118.95 129.17 1aou s ARG 48 Ca -0.04 0.90 0.03 0.00 -2.50 0.00 0.00 55.73 54.12 1aou s ARG 48 Cb -0.12 -3.51 0.15 0.00 0.06 0.00 0.00 34.95 31.53 1aou s ARG 48 CO -0.05 -0.11 0.36 0.34 -2.50 0.00 0.00 175.30 173.34 1aou s ASP 49 N 0.98 1.33 0.65 -2.12 2.15 -0.82 -0.97 116.67 117.88 1aou s ASP 49 Ca 0.37 -1.54 -0.07 0.00 0.43 0.00 0.00 52.55 51.74 1aou s ASP 49 Cb -0.17 0.49 0.03 0.00 -0.30 0.00 0.00 42.92 42.98 1aou s ASP 49 CO 0.15 -0.28 0.97 0.86 -0.17 0.00 0.00 175.17 176.71 1aou s TRP 50 N 1.50 3.09 0.02 -5.34 -0.00 -1.26 -3.11 118.94 113.84 1aou s TRP 50 Ca 0.16 0.57 -0.17 0.00 -0.00 0.00 0.00 56.10 56.66 1aou s TRP 50 Cb -0.16 -2.98 0.03 0.00 -0.00 0.00 0.00 33.47 30.36 1aou s TRP 50 CO -0.06 -1.14 0.36 -0.51 -0.00 0.00 0.00 176.95 175.61 1aou s ASP 51 N -4.41 -0.23 -0.22 5.86 1.01 -0.47 -4.84 116.67 113.37 1aou s ASP 51 Ca 0.57 0.01 0.00 0.00 0.71 0.00 0.00 52.55 53.84 1aou s ASP 51 Cb -0.11 0.37 0.19 0.00 1.01 0.00 0.00 42.92 44.39 1aou s ASP 51 CO 0.45 -0.58 1.78 -0.90 0.21 0.00 0.00 175.17 176.13 1aou n ASP 52 N 0.80 5.18 -0.16 0.27 5.68 -1.26 -2.44 116.55 124.63 1aou n ASP 52 Ca -0.20 -2.80 0.00 0.00 -0.50 0.00 0.00 54.79 51.30 1aou n ASP 52 Cb 0.58 -0.92 0.00 0.00 -1.14 0.00 0.00 41.12 39.65 1aou n ASP 52 CO 0.00 0.00 0.00 0.23 -1.33 0.00 0.00 177.20 176.10 1aou n MET 53 N 0.37 0.00 0.00 0.11 2.81 -1.26 -4.93 117.12 114.22 1aou n MET 53 Ca 0.23 -0.55 0.00 0.00 -1.81 0.00 0.00 57.70 55.57 1aou n MET 53 Cb 0.69 -0.42 0.00 0.00 -0.71 0.00 0.00 33.22 32.78 1aou n MET 53 CO 0.00 0.00 0.00 0.36 1.51 0.00 0.00 175.97 177.84 1aou n LYS 54 N 0.00 0.00 0.00 0.03 2.85 -1.23 -5.16 118.16 114.65 1aou n LYS 54 Ca 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.26 1aou n LYS 54 Cb 0.55 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.93 1aou n LYS 54 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1aou n GLY 55 N -0.17 0.35 3.86 2.58 0.00 -1.02 -5.00 105.19 105.79 1aou n GLY 55 Ca 0.00 -2.29 -0.29 0.00 0.00 0.00 0.00 46.02 43.44 1aou n GLY 55 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1aou s ASP 56 N -4.00 4.43 0.36 1.61 1.01 -1.26 -1.37 116.67 117.44 1aou s ASP 56 Ca 0.00 0.93 -0.17 0.00 0.71 0.00 0.00 52.55 54.02 1aou s ASP 56 Cb 0.00 -1.51 0.06 0.00 1.01 0.00 0.00 42.92 42.47 1aou s ASP 56 CO 0.00 -1.97 0.81 -1.00 0.21 0.00 0.00 175.17 173.23 1aou s HIS 57 N -3.44 0.09 -0.30 4.23 3.76 -1.18 -4.85 115.29 113.61 1aou s HIS 57 Ca 0.62 -0.73 -0.08 0.00 -0.15 0.00 0.00 55.06 54.72 1aou s HIS 57 Cb -0.12 0.82 0.14 0.00 1.11 0.00 0.00 32.58 34.53 1aou s HIS 57 CO 0.51 -1.48 0.64 0.08 -0.85 0.00 0.00 174.74 173.64 1aou s VAL 58 N -2.39 -0.99 0.04 -0.90 1.01 -1.26 -1.94 120.40 113.96 1aou s VAL 58 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 61.98 62.14 1aou s VAL 58 Cb -0.05 -1.00 0.01 0.00 0.00 0.00 0.00 36.38 35.34 1aou s VAL 58 CO 0.10 0.00 0.06 1.17 0.00 0.00 0.00 175.10 176.43 1aou n LYS 59 N 5.44 0.88 -3.58 2.72 3.00 -0.17 -4.85 118.16 121.60 1aou n LYS 59 Ca -0.10 -0.20 -0.14 0.00 -0.00 0.00 0.00 58.31 57.87 1aou n LYS 59 Cb 0.49 -0.02 -0.06 0.00 0.00 0.00 0.00 35.03 35.45 1aou n LYS 59 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.40 176.39 1aou s HIS 60 N 0.60 -0.44 -0.33 5.64 3.76 -1.26 -1.40 115.29 121.85 1aou s HIS 60 Ca 0.04 0.56 0.01 0.00 -0.15 0.00 0.00 55.06 55.52 1aou s HIS 60 Cb -0.00 0.33 0.10 0.00 1.11 0.00 0.00 32.58 34.12 1aou s HIS 60 CO 0.03 -0.62 0.10 0.71 -0.85 0.00 0.00 174.74 174.10 1aou s TYR 61 N -2.16 2.36 -0.14 1.40 2.02 0.20 -4.93 117.35 116.10 1aou s TYR 61 Ca -0.07 -2.19 -0.29 0.00 -0.37 0.00 0.00 57.07 54.16 1aou s TYR 61 Cb -0.01 -2.10 -0.05 0.00 -0.40 0.00 0.00 41.96 39.39 1aou s TYR 61 CO 0.01 -0.89 1.89 0.21 -1.57 0.00 0.00 175.55 175.20 1aou s LYS 62 N 1.28 3.71 0.31 -0.62 2.36 -1.26 -0.30 119.74 125.23 1aou s LYS 62 Ca 0.11 2.05 -0.07 0.00 -2.55 0.00 0.00 55.97 55.52 1aou s LYS 62 Cb -0.18 -4.17 -0.06 0.00 -1.05 0.00 0.00 37.83 32.37 1aou s LYS 62 CO -0.18 -1.42 0.61 0.42 1.55 0.00 0.00 175.35 176.33 1aou s ILE 63 N 5.85 4.96 0.10 5.43 1.09 0.01 -4.74 121.20 133.91 1aou s ILE 63 Ca 0.85 0.22 -0.02 0.00 -1.10 0.00 0.00 60.65 60.60 1aou s ILE 63 Cb -0.33 -3.73 -0.03 0.00 -1.06 0.00 0.00 42.46 37.32 1aou s ILE 63 CO 0.34 -0.36 0.05 -0.13 -0.10 0.00 0.00 174.94 174.75 1aou s ARG 64 N -3.58 0.81 -0.22 2.79 1.81 -1.06 -1.51 118.95 118.00 1aou s ARG 64 Ca 0.46 -1.29 -0.04 0.00 -1.72 0.00 0.00 55.73 53.14 1aou s ARG 64 Cb -0.11 0.25 -0.01 0.00 -0.45 0.00 0.00 34.95 34.63 1aou s ARG 64 CO 0.30 -0.21 -0.04 0.21 -0.68 0.00 0.00 175.30 174.88 1aou s LYS 65 N -3.98 3.42 0.01 3.54 2.20 -1.26 -2.00 119.74 121.67 1aou s LYS 65 Ca 0.15 -0.61 -0.21 0.00 -0.36 0.00 0.00 55.97 54.94 1aou s LYS 65 Cb 0.07 -3.02 -0.06 0.00 -1.51 0.00 0.00 37.83 33.32 1aou s LYS 65 CO -0.04 -0.15 0.62 -0.51 -0.36 0.00 0.00 175.35 174.90 1aou s LEU 66 N 1.38 4.43 0.21 5.43 1.02 -0.60 -4.90 118.68 125.65 1aou s LEU 66 Ca 0.05 1.22 0.23 0.00 0.02 0.00 0.00 54.13 55.64 1aou s LEU 66 Cb -0.14 -2.97 0.92 0.00 0.02 0.00 0.00 46.19 44.02 1aou s LEU 66 CO -0.02 0.11 1.69 0.47 0.02 0.00 0.00 176.35 178.62 1aou n ASP 67 N 2.63 0.58 -0.01 2.29 9.92 -1.26 -1.31 116.55 129.39 1aou n ASP 67 Ca -0.07 0.63 0.13 0.00 -0.53 0.00 0.00 54.79 54.96 1aou n ASP 67 Cb 0.51 -0.76 0.49 0.00 -0.64 0.00 0.00 41.12 40.72 1aou n ASP 67 CO 0.00 0.00 0.00 0.59 0.13 0.00 0.00 177.20 177.92 1aou n ASN 68 N -2.13 0.22 0.00 -2.24 3.02 -1.26 -4.85 115.26 108.02 1aou n ASN 68 Ca 0.03 0.13 0.00 0.00 -0.03 0.00 0.00 54.58 54.71 1aou n ASN 68 Cb 0.24 -0.19 0.00 0.00 -0.61 0.00 0.00 39.78 39.22 1aou n ASN 68 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1aou n GLY 69 N 1.48 -0.46 0.00 7.41 0.00 -0.43 -5.14 105.19 108.04 1aou n GLY 69 Ca 0.07 0.31 0.00 0.00 0.00 0.00 0.00 46.02 46.40 1aou n GLY 69 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1aou n GLY 70 N -0.00 -1.64 3.35 -0.02 0.00 -0.99 -4.80 105.19 101.09 1aou n GLY 70 Ca 0.00 0.74 -0.32 0.00 0.00 0.00 0.00 46.02 46.44 1aou n GLY 70 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1aou s TYR 71 N 0.67 2.60 -0.24 1.61 2.02 -0.37 -1.56 117.35 122.08 1aou s TYR 71 Ca 0.00 -0.56 -0.14 0.00 -0.37 0.00 0.00 57.07 56.00 1aou s TYR 71 Cb 0.00 -1.67 0.07 0.00 -0.40 0.00 0.00 41.96 39.97 1aou s TYR 71 CO 0.00 -0.11 0.59 1.52 -1.57 0.00 0.00 175.55 175.98 1aou s TYR 72 N -0.18 -0.92 -0.22 2.71 1.13 -0.85 0.15 117.35 119.17 1aou s TYR 72 Ca -0.02 1.85 0.19 0.00 -1.41 0.00 0.00 57.07 57.68 1aou s TYR 72 Cb -0.14 0.52 0.04 0.00 -1.10 0.00 0.00 41.96 41.28 1aou s TYR 72 CO 0.03 -0.47 1.19 0.82 -2.51 0.00 0.00 175.55 174.61 1aou h ILE 73 N 5.21 0.38 -3.75 -3.49 2.04 -1.84 -2.81 117.51 113.25 1aou h ILE 73 Ca -0.32 -1.63 -0.21 0.00 1.00 0.00 0.00 64.86 63.71 1aou h ILE 73 Cb 1.21 2.00 -0.26 0.00 -0.74 0.00 0.00 36.82 39.03 1aou h ILE 73 CO 0.20 0.22 -0.68 0.28 0.00 0.00 0.00 178.15 178.17 1aou s THR 74 N -3.10 0.03 0.41 -0.27 -1.32 -1.26 -4.84 115.64 105.29 1aou s THR 74 Ca 0.01 -0.28 0.30 0.00 -1.21 0.00 0.00 61.69 60.51 1aou s THR 74 Cb 0.08 -0.12 0.30 0.00 -1.51 0.00 0.00 72.50 71.25 1aou s THR 74 CO 0.76 -0.16 1.91 0.71 -2.21 0.00 0.00 174.62 175.64 1aou h THR 75 N 4.94 0.00 -1.21 5.08 1.35 -2.01 -1.78 112.91 119.29 1aou h THR 75 Ca -0.27 0.00 0.35 0.00 -0.55 0.00 0.00 66.41 65.94 1aou h THR 75 Cb 1.21 0.67 -0.06 0.00 -1.73 0.00 0.00 68.15 68.24 1aou h THR 75 CO 0.47 0.00 0.86 -0.09 -0.25 0.00 0.00 175.52 176.50 1aou h ARG 76 N 0.00 0.05 -1.04 4.72 9.65 -1.95 -3.41 114.38 122.41 1aou h ARG 76 Ca 0.00 -0.00 0.18 0.00 -1.10 0.00 0.00 59.98 59.06 1aou h ARG 76 Cb 0.34 -0.01 -0.29 0.00 -1.39 0.00 0.00 29.97 28.62 1aou h ARG 76 CO 0.00 0.03 0.52 0.00 2.80 0.00 0.00 179.97 183.32 1aou s ALA 77 N -5.02 -2.66 0.14 2.80 0.00 -0.67 -5.13 121.76 111.22 1aou s ALA 77 Ca -0.06 2.03 0.02 0.00 0.00 0.00 0.00 51.96 53.95 1aou s ALA 77 Cb 0.24 -1.97 0.02 0.00 0.00 0.00 0.00 23.12 21.41 1aou s ALA 77 CO 0.81 -0.54 0.15 1.04 0.00 0.00 0.00 175.76 177.22 1aou n GLN 78 N 3.84 1.09 -0.93 0.00 1.13 -1.26 -4.45 117.38 116.81 1aou n GLN 78 Ca -0.14 -0.81 0.00 0.00 -1.94 0.00 0.00 57.00 54.10 1aou n GLN 78 Cb 0.56 0.01 0.00 0.00 0.11 0.00 0.00 30.24 30.92 1aou n GLN 78 CO 0.00 0.00 0.00 1.19 -1.44 0.00 0.00 177.06 176.81 1aou n PHE 79 N -1.07 -0.35 -0.05 1.08 3.01 0.39 -4.83 117.46 115.63 1aou n PHE 79 Ca 0.02 0.00 -0.04 0.00 1.01 0.00 0.00 57.45 58.44 1aou n PHE 79 Cb 0.15 0.00 -0.10 0.00 -0.01 0.00 0.00 39.48 39.52 1aou n PHE 79 CO 0.00 0.00 0.00 -0.85 1.01 0.00 0.00 176.76 176.92 1aou n GLU 80 N 0.00 1.65 -3.81 -1.08 0.28 -1.26 -1.23 120.64 115.19 1aou n GLU 80 Ca 0.00 -0.03 -0.14 0.00 -0.16 0.00 0.00 57.16 56.83 1aou n GLU 80 Cb 0.00 -1.33 -0.04 0.00 1.43 0.00 0.00 31.44 31.50 1aou n GLU 80 CO 0.00 0.00 0.00 -2.37 -0.16 0.00 0.00 177.13 174.60 1aou n THR 81 N -2.39 0.00 0.04 3.84 5.66 -1.26 -4.63 114.28 115.54 1aou n THR 81 Ca -0.18 -1.78 -0.09 0.00 -3.05 0.00 0.00 64.05 58.95 1aou n THR 81 Cb 0.82 1.01 -0.13 0.00 -1.55 0.00 0.00 70.33 70.49 1aou n THR 81 CO 0.00 0.00 0.00 -0.07 -3.05 0.00 0.00 175.07 171.95 1aou h LEU 82 N 0.00 0.08 -0.69 1.09 3.38 -1.98 -2.65 115.31 114.53 1aou h LEU 82 Ca -0.23 -0.10 -0.13 0.00 0.09 0.00 0.00 57.88 57.50 1aou h LEU 82 Cb 1.06 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.77 1aou h LEU 82 CO 0.32 1.09 -0.64 -0.61 0.09 0.00 0.00 178.44 178.69 1aou h GLN 83 N 0.01 0.00 -0.10 1.13 4.15 -1.97 0.40 115.11 118.73 1aou h GLN 83 Ca -0.13 0.00 -0.17 0.00 0.77 0.00 0.00 58.65 59.13 1aou h GLN 83 Cb 1.88 0.00 0.01 0.00 0.21 0.00 0.00 27.48 29.58 1aou h GLN 83 CO 0.12 0.64 -0.58 1.96 -1.93 0.00 0.00 178.83 179.04 1aou h GLN 84 N 0.00 0.57 0.00 1.69 7.50 -1.96 -1.91 115.11 121.01 1aou h GLN 84 Ca -0.01 -0.48 -0.14 0.00 0.50 0.00 0.00 58.65 58.53 1aou h GLN 84 Cb 1.15 0.10 -0.02 0.00 0.05 0.00 0.00 27.48 28.77 1aou h GLN 84 CO 0.08 1.11 -0.65 1.37 -1.50 0.00 0.00 178.83 179.24 1aou h LEU 85 N 0.19 0.00 -0.95 1.46 8.10 -1.43 -2.23 115.31 120.45 1aou h LEU 85 Ca -0.04 0.00 -0.04 0.00 0.11 0.00 0.00 57.88 57.91 1aou h LEU 85 Cb 1.23 0.00 -0.01 0.00 -0.44 0.00 0.00 40.66 41.45 1aou h LEU 85 CO 0.12 0.65 -0.19 -0.37 -4.11 0.00 0.00 178.44 174.54 1aou h VAL 86 N 0.00 0.43 -0.26 0.15 -1.51 -0.91 0.17 116.25 114.32 1aou h VAL 86 Ca -0.01 -1.11 -0.08 0.00 -1.23 0.00 0.00 66.70 64.28 1aou h VAL 86 Cb 1.36 1.81 -0.01 0.00 -2.13 0.00 0.00 31.29 32.32 1aou h VAL 86 CO 0.08 0.19 -0.14 -0.61 -1.23 0.00 0.00 177.57 175.86 1aou h GLN 87 N 0.00 0.55 0.06 5.19 5.75 -0.76 0.50 115.11 126.40 1aou h GLN 87 Ca -0.00 -0.24 -0.27 0.00 -0.15 0.00 0.00 58.65 57.98 1aou h GLN 87 Cb 0.79 -0.01 0.02 0.00 1.07 0.00 0.00 27.48 29.35 1aou h GLN 87 CO 0.02 0.81 -1.12 1.25 -2.65 0.00 0.00 178.83 177.14 1aou h HIS 88 N 0.27 0.85 0.00 3.99 2.76 -1.16 -2.96 115.15 118.91 1aou h HIS 88 Ca 0.06 -0.51 0.00 0.00 -2.20 0.00 0.00 60.37 57.72 1aou h HIS 88 Cb 0.65 -0.08 0.00 0.00 1.55 0.00 0.00 27.41 29.53 1aou h HIS 88 CO 0.06 1.35 0.00 0.66 -1.30 0.00 0.00 177.93 178.70 1aou n TYR 89 N -3.76 0.57 0.14 5.26 4.02 0.55 -1.67 117.16 122.26 1aou n TYR 89 Ca -0.11 0.22 -0.24 0.00 -0.01 0.00 0.00 57.90 57.76 1aou n TYR 89 Cb 0.93 -0.86 -0.16 0.00 -0.02 0.00 0.00 39.34 39.23 1aou n TYR 89 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 176.86 176.88 1aou h SER 90 N 0.00 0.80 0.85 7.72 0.87 -0.72 -3.30 113.55 119.77 1aou h SER 90 Ca 0.00 -0.88 0.00 0.00 -1.23 0.00 0.00 61.79 59.68 1aou h SER 90 Cb 0.34 -0.26 0.00 0.00 -0.44 0.00 0.00 62.40 62.04 1aou h SER 90 CO 0.00 1.69 -0.65 -0.62 -0.53 0.00 0.00 176.83 176.72 1aou n GLU 91 N -3.69 0.30 -3.62 2.24 1.02 -1.09 -4.92 120.64 110.87 1aou n GLU 91 Ca -0.17 0.08 -0.13 0.00 -0.02 0.00 0.00 57.16 56.92 1aou n GLU 91 Cb 1.10 -1.68 -0.06 0.00 -0.02 0.00 0.00 31.44 30.78 1aou n GLU 91 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1aou s ARG 92 N -3.17 0.99 0.43 3.49 0.52 -0.67 -5.01 118.95 115.53 1aou s ARG 92 Ca 0.06 -0.35 0.19 0.00 -0.52 0.00 0.00 55.73 55.12 1aou s ARG 92 Cb 0.13 0.45 1.13 0.00 0.52 0.00 0.00 34.95 37.18 1aou s ARG 92 CO 0.73 -0.35 1.87 0.00 0.02 0.00 0.00 175.30 177.56 1aou h ALA 93 N 2.83 2.27 0.00 2.13 0.00 -1.82 -3.31 119.26 121.37 1aou h ALA 93 Ca -0.31 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.61 1aou h ALA 93 Cb 1.22 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.99 1aou h ALA 93 CO 0.43 -0.55 0.00 0.00 0.00 0.00 0.00 179.25 179.13 1aou n ALA 94 N -2.54 0.00 0.00 0.00 0.00 -1.26 -3.90 120.51 112.81 1aou n ALA 94 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.63 1aou n ALA 94 Cb 0.71 -0.19 0.00 0.00 0.00 0.00 0.00 19.45 19.98 1aou n ALA 94 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1aou n GLY 95 N -2.84 3.52 3.73 0.00 0.00 -1.26 -4.83 105.19 103.51 1aou n GLY 95 Ca 0.00 -0.97 -0.25 0.00 0.00 0.00 0.00 46.02 44.80 1aou n GLY 95 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 1aou n LEU 96 N 0.00 0.00 -2.32 0.99 -0.00 -1.25 -4.97 117.00 109.44 1aou n LEU 96 Ca 0.00 -1.78 -0.35 0.00 -0.00 0.00 0.00 56.01 53.88 1aou n LEU 96 Cb 0.00 -0.77 0.08 0.00 -0.00 0.00 0.00 43.42 42.73 1aou n LEU 96 CO 0.00 -1.15 1.43 -1.20 -0.00 0.00 0.00 177.39 176.47 1aou n SER 97 N -3.28 7.65 -3.34 1.45 7.64 -1.26 -4.62 113.62 117.85 1aou n SER 97 Ca 0.16 -3.79 -0.14 0.00 1.01 0.00 0.00 58.87 56.12 1aou n SER 97 Cb 0.56 -0.97 -0.07 0.00 -1.01 0.00 0.00 64.21 62.72 1aou n SER 97 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1aou s SER 98 N -1.86 0.90 -1.25 6.43 0.15 -1.26 -5.06 113.70 111.76 1aou s SER 98 Ca 0.65 -0.97 -0.20 0.00 0.70 0.00 0.00 55.95 56.13 1aou s SER 98 Cb 0.51 0.79 0.00 0.00 -1.71 0.00 0.00 66.02 65.61 1aou s SER 98 CO -0.01 -0.32 1.82 -0.13 1.20 0.00 0.00 173.24 175.81 1aou s ARG 99 N 2.02 3.34 0.00 5.44 0.52 -1.26 -4.88 118.95 124.13 1aou s ARG 99 Ca 0.13 -1.64 0.00 0.00 -0.52 0.00 0.00 55.73 53.70 1aou s ARG 99 Cb -0.13 -5.41 0.00 0.00 0.52 0.00 0.00 34.95 29.93 1aou s ARG 99 CO -0.19 -3.01 0.00 1.47 0.02 0.00 0.00 175.30 173.59 1aou n LEU 100 N 11.00 0.00 -4.72 2.53 -0.00 -1.25 -4.36 117.00 120.20 1aou n LEU 100 Ca 0.47 0.00 -0.40 0.00 -0.00 0.00 0.00 56.01 56.08 1aou n LEU 100 Cb 0.46 0.00 -0.05 0.00 -0.00 0.00 0.00 43.42 43.84 1aou n LEU 100 CO 0.73 0.00 0.40 -0.69 -0.00 0.00 0.00 177.39 177.83 1aou s VAL 101 N 0.00 5.03 0.20 1.47 1.01 0.72 -2.62 120.40 126.21 1aou s VAL 101 Ca 0.00 1.45 -0.30 0.00 0.00 0.00 0.00 61.98 63.13 1aou s VAL 101 Cb 0.00 -4.04 -0.16 0.00 0.00 0.00 0.00 36.38 32.18 1aou s VAL 101 CO 0.00 0.26 0.86 0.55 0.00 0.00 0.00 175.10 176.77 1aou n VAL 102 N 3.71 1.53 0.09 2.92 3.14 -0.92 -4.73 118.33 124.06 1aou n VAL 102 Ca -0.01 -0.38 -0.13 0.00 -2.96 0.00 0.00 64.34 60.86 1aou n VAL 102 Cb 0.51 -0.47 -0.09 0.00 -1.06 0.00 0.00 33.84 32.73 1aou n VAL 102 CO 0.00 0.00 0.00 1.55 -6.46 0.00 0.00 176.83 171.92 1aou h PRO 103 N 2.04 0.26 -2.77 1.45 0.13 -1.93 -3.35 132.00 127.82 1aou h PRO 103 Ca -0.37 -0.36 -0.80 0.00 -0.87 0.00 0.00 66.00 63.60 1aou h PRO 103 Cb 1.39 0.12 -0.26 0.00 0.13 0.00 0.00 31.00 32.37 1aou h PRO 103 CO 0.62 1.11 0.99 0.43 -0.23 0.00 0.00 178.00 180.92 1aou n SER 104 N -3.59 6.65 -4.46 1.44 7.64 -1.26 -5.02 113.62 115.01 1aou n SER 104 Ca -0.06 -3.46 -0.54 0.00 1.01 0.00 0.00 58.87 55.82 1aou n SER 104 Cb 0.92 -1.26 -0.06 0.00 -1.01 0.00 0.00 64.21 62.81 1aou n SER 104 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 1aou n HIS 105 N 1.13 0.18 0.00 1.43 8.25 -1.26 -5.25 115.22 119.70 1aou n HIS 105 Ca 0.33 1.00 0.00 0.00 -0.26 0.00 0.00 57.72 58.80 1aou n HIS 105 Cb 0.31 -2.04 0.00 0.00 1.12 0.00 0.00 29.99 29.38 1aou n HIS 105 CO 0.00 0.00 0.00 1.17 0.64 0.00 0.00 176.34 178.15